SCHEMBL1952607

SCHEMBL1952607

C=CCCCCCC(N)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
ALDH1A1 P00352 4/20 0.44
USP2 O75604 3/20 0.44
CYP3A4 P08684 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 2/20 0.40
RECQL P46063 1/20 0.39
ABCC4 O15439 1/20 0.37
LTA4H P09960 1/20 0.34
NOS1 P29475 2/20 0.33
DDAH1 O94760 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1952608 1.00 MAPT (0.44) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL6883354 1.00 MAPT (0.44) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL10166818 0.87 LTA4H (0.36) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL20496961 0.87 NOS1 (0.40) CYP3A4LTA4HNOS1NOS3NOS2
SCHEMBL16418495 0.84 MAPT (0.47) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL16421121 0.84 MAPT (0.47) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL12549290 0.83 MAPT (0.46) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL24298179 0.82 ALDH1A1 (0.51) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL7872976 0.82 ALDH1A1 (0.51) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL1128635 0.82 ALDH1A1 (0.51) MAPTALDH1A1USP2CYP3A4SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8927484-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2015-01-06 US disclosed
US-20110135599-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2011-06-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110135599-A1 ANTIVIRAL COMPOUNDS EIF2AK2, MAVS, HAVCR2 MAPT 4252/4885ALDH1A1 3535/4885USP2 1186/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.